InChI's in LaTex and CDK News
Egon Willighagen · 2006
An InChI (or see the FAQ) is a line notation for a molecular structure that was recently developed by the NIST and the IUPAC. Principally they can be applied to protein too (see below), but because proteins would give lenghty InChI's and are quite well defined in terms of connectivity anyway, those can better be described by their amino acid sequence.